4-chloranyl-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[2-(2-ethylanilino)-2-oxo-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[2-(2-ethylanilino)-2-keto-ethyl]-N-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H26ClN3O4S/c1-3-16-8-4-5-9-19(16)24-21(27)15-25(2)22(28)17-10-11-18(23)20(14-17)31(29,30)26-12-6-7-13-26/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3,(H,24,27)